Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GRM8 | O00222 | 1/20 | 0.31 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.31 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29711836 | 1.00 | ALDH1A1 (0.36) | ALDH1A1PKMPIK3CAMAPTXDH | |
| SCHEMBL29711775 | 1.00 | ALDH1A1 (0.36) | ALDH1A1PKMPIK3CAMAPTXDH | |
| SCHEMBL28951001 | 1.00 | ALDH1A1 (0.36) | ALDH1A1PKMPIK3CAMAPTXDH | |
| SCHEMBL22425771 | 0.79 | MAPT (0.41) | PIK3CAMAPTTACR1 | |
| SCHEMBL29711746 | 0.78 | PPARA (0.37) | ALDH1A1 | |
| SCHEMBL24496961 | 0.78 | PPARA (0.37) | ALDH1A1 | |
| SCHEMBL29711764 | 0.78 | PPARA (0.37) | ALDH1A1 | |
| SCHEMBL29711761 | 0.77 | ALDH1A1 (0.56) | ALDH1A1PKMMAPTLMNAGAA | |
| SCHEMBL29711644 | 0.77 | ALDH1A1 (0.56) | ALDH1A1PKMMAPTLMNAGAA | |
| SCHEMBL28951000 | 0.77 | ALDH1A1 (0.56) | ALDH1A1PKMMAPTLMNAGAA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114591351-B | Polycyclic compound and preparation method and application thereof | 成都科岭源医药技术有限公司 | 2023-12-05 | — | — | CN | disclosed |
| WO-2022117090-A1 | POLYCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 成都科岭源医药技术有限公司 | 2022-06-09 | — | — | WO | disclosed |
| CN-114591351-A | Polycyclic compound and preparation method and application thereof | 成都科岭源医药技术有限公司 | 2022-06-07 | — | — | CN | disclosed |